Simulation of the interaction of plastic zone dislocations with the grain boundary at brittle-plastic transition temperatures in molybdenum

2021 ◽  
Vol 2021 (3) ◽  
pp. 77-85
Author(s):  
K. M. Borysovska ◽  
◽  
N. M. Marchenko ◽  
Yu. M. Podrezov ◽  
S. O. Firstov ◽  
...  

The (DD) method was used to model the formation of the plastic zone of the top of the cracks in polycrystalline molybdenum. Special attention was paid to take into account the interaction of dislocations in the plastic zone with grain boundaries. Structural sensitivity of fracture toughness was analyzed under brittle-ductile condition. Simulations were performed for a range of grain sizes from 400 to 100 μm, at which a sudden increase in fracture toughness with a decrease of grain size was experimentally shown. We calculated the value of K1c taking into account the shielding action of dislocations. The position of all dislocations in the plastic zone at fracture moment was calculated. Based on these data, we obtained the dependences of dislocation density on the distance from the crack tip thereby confirming significant influence of the grain boundaries on plastic zone formation. At large grain sizes, when the plastic zone does not touch the boundary, the distribution of dislocations remained unchanged. As grains reduce their size to size of the plastic zone, they start formating a dislocation pile – up near the boundaries. Dislocations on plastic zone move slightly toward the crack tip, but the density of dislocations in the middle of the grain remains unchanged, and fracture toughness remains almost unchanged. Further reduction of the grain size leads to the Frank-Reed source activation on the grain boundary Forming dislocation pile-up of the neighbor grains. Its stress concentration acts on dislocations of the first grain and causes redistribution of plastic zone dislocations. If the reduction in grain size is not enough to form a strong pile-up, density of dislocations on plastic zone increases slightly and crack resistance increases a few percent. Further reduction of grains promotes strong pile-up, dislocations move to crack tip, and its density on plastic zone increases. Crack is shielded and fracture toughness increases sharply. The calculation showed that the fracture toughness jump is observed at grain sizes of 100—150 μm, in good agreement with the experiment. Keywords: dislocation dynamics simulation, molybdenum, fracture toughness, grain size, plastic zone, brittle-ductile transition.

2012 ◽  
Vol 715-716 ◽  
pp. 186-190 ◽  
Author(s):  
Luis A. Barrales Mora ◽  
Lasar S. Shvindlerman ◽  
Günter Gottstein

In a previous work [ we introduced the geometry of a granular system that allowed the study of the effect of a finite mobility of the quadruple and triple junctions on grain boundary migration. One of the most important conclusions of this work was that the triple junctions drag more effectively the motion of the grain boundaries than the quadruple junctions. Nevertheless, this conclusion was drawn without consideration of the grain size. For this reason, this conclusion might be contradictory with our understanding of the grain boundary junctions because while the effect of the triple lines is inverse linear with the grain size that of the quadruple junctions is proportional to the inverse square of the grain size and thus, quadruple junctions are expected to drag more effectively, at least, for very small grain sizes. In the present investigation, we studied comprehensively the effect of grain size on the evolution of the granular system under the assumption of a finite mobility of the boundary junctions. For this purpose, several network model simulations were carried out for different grain sizes ranging from nanoto micrometers using a fully periodic grain arrangement. The results seem to corroborate that the triple junctions drag more effectively the motion of the grain boundaries, however, for very low junction mobility and grain sizes the effect appears to be indistinguishable. It was also observed that for very low quadruple junction mobility the geometry of the granular system undergoes a severe transformation which results in the unfulfillment of the equation derived in [.


2005 ◽  
Vol 297-300 ◽  
pp. 1672-1677
Author(s):  
Min Chul Kim ◽  
Bong Sang Lee ◽  
Won Jon Yang ◽  
Jun Hwa Hong

The effects of the microstructural parameters, such as the prior austenite grain size and carbide size, on the cleavage fracture toughness were investigated in the transition region of Mn-Mo-Ni bainitic low alloy steels. Cleavage fracture toughness was evaluated by the ASTM standard E 1921 Master curve method. In order to clarify the effects of each microstructure, the grain size and carbide size of the test materials were independently controlled by modifying the heat treatment process. Firstly, the grain sizes were changed from 25㎛ to 110㎛ without any significant changes in the carbide size and shape. Secondly, the average carbide sizes were changed from 0.20 ㎛ to 0.29㎛ but maintaining the initial grain sizes. As a result, the fracture toughness in the transition region did not show any significant dependency on the austenite grain size, while the carbide size showed a close relation to the fracture toughness. Fracture toughness was decreased with an increase of the average carbide size. From the microscopic observation of the fractured surface, the cleavage initiation distance (CID) from the original crack tip showed no direct relationship to the prior austenite grain sizes but a strong relationship to the carbide sizes. However, the measured cleavage fracture toughness was strongly related to the distance from the crack tip to the cleavage initiation site. From the viewpoint of the weakest link theory, the particle size and their distribution in front of the crack tip is probably more important than the grain size in the transition temperature range where the fracture was controlled by the cleavage crack initiation.


1994 ◽  
Vol 362 ◽  
Author(s):  
Ronald W. Armstrong

AbstractThe explanation for the grain size dependence of the polycrystal yield stress or cleavage stress of steel, investigated in complementary studies by Hall and Petch, is rooted in dislocation pile-up theory first described by Eshelby, Frank and Nabarro just a step away from previous theoretical work on the stress concentrating properties of cracks. Beginning from Cottrelllocking of dislocations at grain boundaries by carbon that is responsible for the pronounced yield point behavior and the grain size dependence of the yield strength of steel, the same concepts have been shown to apply for the complete stress/strain behavior of steel and other materials. Other mechanical properties such as fatigue strength show a similar dependence on grain size. A notable application of such grain size based considerations has been to the ductile-brittle transition and fracture toughness properties of steel and related materials — because refinement of grain size both strengthens a material and improves its fracture toughness. Early results for the polycrystal hardness dependence on grain size gave evidence that the strength benefits of grain size refinement ought to extend to ultrafine grain sizes.


2013 ◽  
Vol 32 (6) ◽  
pp. 551-556 ◽  
Author(s):  
Bülent Aktaş

AbstractThe effect of the addition of a small amount of CuO on the microstructure, hardness, fracture toughness and electrical conductivity properties of 8YSZ were investigated using 8 mol% yttria-stabilized cubic zirconia (8YSZ). The addition of 1 wt% CuO to 8YSZ powders were doped using a colloidal process. Undoped and CuO doped 8YSZ specimens were pressureless sintered at 1400 °C for 10 h. The grain size measurement results showed that the presence of CuO as a intergranular second phase at the grain boundaries of the 8YSZ gave rise to a decrease in the grain size. The fracture toughness values for undoped and 1 wt% CuO-doped 8YSZ specimens were obtained as 1.79 and 2.20 MPa.m1/2, respectively. The decrease in the grain size of the 8YSZ with CuO addition caused an increase in the fracture toughness. The electrical conductivity of the undoped and 1 wt% CuO-doped 8YSZ specimens was measured using a frequency response analyzer in the frequency range of 100 mHz–13 MHz and at the temperature range of 300–800 °C. The electrical conductivity results showed that there was a decrease in the grain interior, and specific grain boundary conductivity, with the addition of a small amount of CuO to 8YSZ. The presence of a second phase layer with high resistance at the grain boundaries of the 8YSZ caused a decrease in the specific grain boundary conductivity.


Materials ◽  
2021 ◽  
Vol 14 (23) ◽  
pp. 7199
Author(s):  
Hyunbin Nam ◽  
Jeongwon Kim ◽  
Namkyu Kim ◽  
Sangwoo Song ◽  
Youngsang Na ◽  
...  

In this study, the carburization characteristics of cast and cold-rolled CoCrFeMnNi high-entropy alloys (HEAs) with various grain sizes were investigated. All specimens were prepared by vacuum carburization at 940 °C for 8 h. The carburized/diffused layer was mainly composed of face-centered cubic structures and Cr7C3 carbide precipitates. The carburized/diffused layer of the cold-rolled specimen with a fine grain size (~1 μm) was thicker (~400 μm) than that of the carburized cast specimen (~200 μm) with a coarse grain size (~1.1 mm). In all specimens, the carbides were formed primarily through grain boundaries, and their distribution varied with the grain sizes of the specimens. However, the carbide precipitates of the cast specimen were formed primarily at the grain boundaries and were unequally distributed in the specific grains. Owing to the non-uniform formation of carbides in the carburized cast specimen, the areas in the diffused layer exhibited various carbide densities and hardness distributions. Therefore, to improve the carburization efficiency of equiatomic CoCrFeMnNi HEAs, it is necessary to refine the grain sizes.


2021 ◽  
Author(s):  
Mark Coleman ◽  
Bernhard Grasemann ◽  
David Schneider ◽  
Konstantinos Soukis ◽  
Riccardo Graziani

<p>Microstructures may be used to determine the processes, conditions and kinematics under which deformation occurred. For a given set of these variables, different microstructures are observed in various materials due to the material’s physical properties. Dolomite is a major rock forming mineral, yet the mechanics of dolomite are understudied compared to other ubiquitous minerals such as quartz, feldspar, and calcite. Our new study uses petrographic, structural and electron back scatter diffraction analyses on a series of dolomitic and calcitic mylonites to document differences in deformation styles under similar metamorphic conditions. The Attic-Cycladic Crystalline Complex, Greece, comprises a series of core complexes wherein Miocene low-angle detachment systems offset and juxtapose a footwall of high-pressure metamorphosed rocks against a low-grade hanging wall. This recent tectonic history renders the region an excellent natural laboratory for studying the interplay of the processes that accommodate deformation. The bedrock of Mt. Hymittos, Attica, preserves a pair of ductile-then-brittle normal faults dividing a tripartite tectonostratigraphy. Field observations, mineral assemblages and observable microstructures suggests the tectonic packages decrease in metamorphic grade from upper greenschist facies (~470 °C at 0.8 GPa) in the stratigraphically lowest package to sub-greenschist facies in the stratigraphically highest package. Both low-angle normal faults exhibit cataclastic fault cores that grade into the schists and marbles of their respective hanging walls. The middle and lower tectonostratigraphic packages exhibit dolomitic and calcitic marbles that experienced similar geologic histories of subduction and exhumation. The mineralogically distinct units (calcite vs. dolomite) of the middle package deformed via different mechanisms under the same conditions within the same package and may be contrasted with mineralogically similar units that deformed under higher pressure and temperature conditions in the lower package. In the middle unit, dolomitic rocks are brittlely deformed. Middle unit calcitic marble are mylonitic to ultramylonitic with average grain sizes ranging from 30 to 8 μm. These mylonites evince grain-boundary migration and grain size reduction facilitated by subgrain rotation. Within the lower package, dolomitic and calcitic rocks are both mylonitic to ultramylonitic with grain sizes ranging from 28 to 5 μm and preserve clear crystallographic preferred orientation fabrics. Calcitic mylonites exhibit deformation microstructures similar to those of the middle unit. Distinctively, the dolomitic mylonites of the lower unit reveal ultramylonite bands cross-cutting and overprinting an older coarser mylonitic fabric. Correlated missorientation angles suggest these ultramylonites show evidence for grain size reduction accommodated by microfracturing and subgrain rotation. In other samples the dolomitic ultramylonite is the dominant fabric and is overprinting and causing boudinage of veins and relict coarse mylonite zones. Isolated interstitial calcite grains within dolomite ultramylonites are signatures of localized creep-cavitation processes. Following grain size reduction, grain boundary sliding dominantly accommodated further deformation in the ultramylonitic portions of the samples as indicated by randomly distributed correlated misorientation angles. This study finds that natural deformation of dolomitic rocks may occur by different mechanisms than those identified by published experiments; notably that grain-boundary migration and subgrain rotation may be active in dolomite at much lower temperatures than previously suggested.</p>


2021 ◽  
Author(s):  
Yuelong Wang ◽  
Xingyu Li ◽  
Haoyang Wu ◽  
Baorui Jia ◽  
Deyin Zhang ◽  
...  

Abstract Si3N4-based ceramic (Si3N4-5wt%Y2O3-3wt%MgO) was obtained from carbothermal-reduction-derived powder combined with gas pressure sintering. The phase, microstructure, thermal conductivity and mechanical properties of Si3N4 ceramics were comprehensively analyzed. Dense Si3N4 ceramic with uniform grain size was obtained after sintering at 1900°C for 7 h under a N2 pressure of 1.2 MPa. The secondary phase consisted of Y4Si2O7N2 and Y2Si3O3N4 was found to gather around triangular grain boundaries. The thermal conductivity, flexural strength, hardness and fracture toughness of the Si3N4 ceramics were 95.7 W·m-1·k-1, 715 MPa, 17.2 GPa and 7.2 MPa·m1/2, respectively. The results were compared with product derived from commercial powder, the improvement of thermal conductivity (~8.3%) and fracture toughness (~4.3%) demonstrating the superiority of Si3N4 ceramics prepared from carbothermal-reduction-derived powder.


2002 ◽  
Vol 727 ◽  
Author(s):  
Y. Champion ◽  
P. Langlois ◽  
S. Guérin-Mailly ◽  
C. Langlois ◽  
M. J. Hÿtch

AbstractUnderstanding the mechanical behaviour of metallic nanostructures is a key issue for their development. On the one hand, knowledge of the plastic behaviour at various temperatures is essential to control the synthesis, forming, and machining of such materials. Equally, a clear understanding of atomic and mesoscopic mechanisms, involving defects and their interactions, is essential for the control of ageing and functional properties. Regarding plastic deformation at room temperature, there is now evidence for unusual behaviour in nanostructured metals. In addition to high resistance and ductility, tensile testing reveals peculiar elasto-plastic deformation. Such behaviour was initially attributed to grain-boundary sliding. However, intergranular areas (including triple junctions) may possess special properties compared to their microcrystalline counterparts. For example, low activation energies have been measured for grain-boundary diffusion and it has been observed that grain-boundaries may act as dislocation sources and nucleation sites for deformation twinning.In this paper, we report on analysis on bulk copper nanostructures. Grain-boundaries are studied, by cross-correlating information from mechanical tensile testing and structural analysis, including X-ray diffraction (XRD) and transmission electron microscopy (TEM). Macroscopic bulk specimens (with grain size of about 80 nm) are prepared by powder metallurgy techniques, modified to fit to the special properties of nanocrystalline powders. Processing includes coldisostatic pressing, sintering and differential extrusion. The powders used (grain size of 40 nm) are synthesised by evaporation and cryo-condensation of a metallic vapour within liquid nitrogen. Results on mechanical testing and structural analysis will be reported. Emphasis will be placed on the structure of grain-boundaries (type of grain-boundary, grain-boundary thickness) studied by TEM and high resolution TEM image analysed using the geometric phase technique. The nanostructure was revealed to be consist in agglomerate of nano-size grains separated by low angle grain-boundaries. Agglomerates are themselves separerated by general high angle boundaries. These observations will then be related to the unusual mechanical true stress-true strain curves of the metallic nanostructures.


Solid Earth ◽  
2017 ◽  
Vol 8 (6) ◽  
pp. 1193-1209 ◽  
Author(s):  
James Gilgannon ◽  
Florian Fusseis ◽  
Luca Menegon ◽  
Klaus Regenauer-Lieb ◽  
Jim Buckman

Abstract. Establishing models for the formation of well-mixed polyphase domains in ultramylonites is difficult because the effects of large strains and thermo-hydro-chemo-mechanical feedbacks can obscure the transient phenomena that may be responsible for domain production. We use scanning electron microscopy and nanotomography to offer critical insights into how the microstructure of a highly deformed quartzo-feldspathic ultramylonite evolved. The dispersal of monomineralic quartz domains in the ultramylonite is interpreted to be the result of the emergence of synkinematic pores, called creep cavities. The cavities can be considered the product of two distinct mechanisms that formed hierarchically: Zener–Stroh cracking and viscous grain-boundary sliding. In initially thick and coherent quartz ribbons deforming by grain-size-insensitive creep, cavities were generated by the Zener–Stroh mechanism on grain boundaries aligned with the YZ plane of finite strain. The opening of creep cavities promoted the ingress of fluids to sites of low stress. The local addition of a fluid lowered the adhesion and cohesion of grain boundaries and promoted viscous grain-boundary sliding. With the increased contribution of viscous grain-boundary sliding, a second population of cavities formed to accommodate strain incompatibilities. Ultimately, the emergence of creep cavities is interpreted to be responsible for the transition of quartz domains from a grain-size-insensitive to a grain-size-sensitive rheology.


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